Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM368054
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM368054 |
| SMILES |
C=CC(=C)C#CCNC=O
|
| InChIKey |
KUNAOOFINIDLAK-UHFFFAOYSA-N
|
| MW [Da] |
135.17
Automatically obtained from RDkit software. |
| LogP |
0.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM170688
Similarity: 0.8295
Similarity to MM170688
| Tanimoto metric | 0.8295 |
|---|---|
| Cosine metric | 0.9108 |
| Dice metric | 0.9068 |
| MW: | 121.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM45580
Similarity: 0.7955
Similarity to MM45580
| Tanimoto metric | 0.7955 |
|---|---|
| Cosine metric | 0.8919 |
| Dice metric | 0.8861 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM368052
Similarity: 0.7019
Similarity to MM368052
| Tanimoto metric | 0.7019 |
|---|---|
| Cosine metric | 0.8249 |
| Dice metric | 0.8249 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+337 more
